Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL319050
SMILES CCOc1ccc(cc1OC)/C=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H20N8O6 MW 492.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N8O6/c1-3-33-14-6-4-12(8-16(14)32-2)10-24-26-22(31)18-19(13-5-7-15-17(9-13)35-11-34-15)30(29-25-18)21-20(23)27-36-28-21/h4-10H,3,11H2,1-2H3,(H2,23,27)(H,26,31)/b24-10+InChIKey
XYMLWLTVXCMEHF-YSURURNPSA-NSynonyms
861124-20-1(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(4ethoxy3methoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)(4ethoxy3methoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)(4ethoxy3methoxyphenyl)methylideneamino)triazole4carboxamide
861124201
CCOC1=C(C=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC5=C(C=C4)OCO5)OC
CCOc1ccc(cc1OC)C=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N
InChI=1SC22H20N8O6c1333146412(816(14)322)10242622(31)1819(13571517(913)35113415)30(292518)2120(23)27362821h410H311H212H3(H22327)(H2631)b2410+
MFCD05683589
ZINC000009307856
ZINC97494816
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